Sugi Predict

Sugi Predict / Compounds / Trifluoroacetic Acid

Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL28675164

CC(C)C[C@H](NC(=O)c1ccc(NC[C@@H](N)CS)cc1-c1cccc2ccccc12)C(=O)O.O=C(O)C(F)(F)F

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 18/20 0.91
▸ FNTB P49356 16/20 0.91
▸ PGGT1B P53609 14/20 0.91
▸ TDP1 Q9NUW8 3/20 0.77
▸ BCL2L1 Q07817 1/20 0.44
▸ NTSR1 P30989 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Trifluoroacetic Acid SCHEMBL31146895 1.00 FNTA (0.91) FNTAFNTBPGGT1BTDP1BCL2L1
Trifluoroacetic Acid SCHEMBL28675162 1.00 FNTA (0.91) FNTAFNTBPGGT1BTDP1BCL2L1
SCHEMBL1804295 0.95 FNTA (1.00) FNTAFNTBPGGT1BTDP1BCL2L1
SCHEMBL16499927 0.95 FNTA (1.00) FNTAFNTBPGGT1BTDP1BCL2L1
SCHEMBL16136644 0.95 FNTA (1.00) FNTAFNTBPGGT1BTDP1BCL2L1
Trifluoroacetic Acid SCHEMBL30104219 0.93 FNTA (0.89) FNTAFNTBPGGT1BTDP1
Trifluoroacetic Acid SCHEMBL16499780 0.93 FNTA (0.89) FNTAFNTBPGGT1BTDP1
Trifluoroacetic Acid SCHEMBL16499777 0.93 FNTA (0.89) FNTAFNTBPGGT1BTDP1
SCHEMBL14169141 0.88 FNTA (0.87) FNTAFNTBPGGT1BTDP1
SCHEMBL25211622 0.88 FNTA (0.81) FNTAFNTBPGGT1BTDP1BCL2L1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113747883-A Inhalation of statins as bronchodilators to improve pulmonary function in respiratory diseases 加利福尼亚大学董事会 2021-12-03 — — CN disclosed